methyl 4-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(diethylcarbamothioylsulfanyl)ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]benzoate CAS Name: 4-[[2-[[diethylamino(sulfanylidene)methyl]thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(diethylcarbamothioylsulfanyl)acetyl]amino]benzoate Traditional Name: 4-[[2-(diethylthiocarbamoylthio)acetyl]amino]benzoic acid methyl ester Formula: C15H20N2O3S2 MolecularWeight: 340.4609

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H20N2O3S2/c1-4-17(5-2)15(21)22-10-13(18)16-12-8-6-11(7-9-12)14(19)20-3/h6-9H,4-5,10H2,1-3H3,(H,16,18)